General Information of the Compound
| Compound ID |
CP0565469
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| Compound Name |
(2-aminophenyl)-[1-[3-(trifluoromethyl)phenyl]triazol-4-yl]methanone
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| Structure |
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| Formula |
C16H11F3N4O
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| Molecular Weight |
332.285
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| Canonical SMILES |
Nc1ccccc1C(=O)c1cn(nn1)-c1cccc(c1)C(F)(F)F
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| InChI |
InChI=1S/C16H11F3N4O/c17-16(18,19)10-4-3-5-11(8-10)23-9-14(21-22-23)15(24)12-6-1-2-7-13(12)20/h1-9H,20H2
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| InChIKey |
BLZOSSTXXHTXFN-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound